methyl 2-[3-[(4-bromophenyl)carbonylamino]propanoylamino]-4-methyl-pentanoate

Systemtic Name: methyl 2-[3-[(4-bromophenyl)carbonylamino]propanoylamino]-4-methyl-pentanoate Openeye Name: methyl 2-[3-[(4-bromobenzoyl)amino]propanoylamino]-4-methyl-pentanoate CAS Name: 2-[[3-[[(4-bromophenyl)-oxomethyl]amino]-1-oxopropyl]amino]-4-methylpentanoic acid methyl ester IUPAC Name: methyl 2-[3-[(4-bromobenzoyl)amino]propanoylamino]-4-methylpentanoate Traditional Name: 2-[3-[(4-bromobenzoyl)amino]propanoylamino]-4-methyl-valeric acid methyl ester Formula: C17H23BrN2O4 MolecularWeight: 399.27952

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Descriptors Computed from Structure

Canonical SMILES:

CC(C)CC(C(=O)OC)NC(=O)CCNC(=O)C1=CC=C(C=C1)Br

Isomeric SMILES

CC(C)CC(C(=O)OC)NC(=O)CCNC(=O)C1=CC=C(C=C1)Br

InChI

InChI=1S/C17H23BrN2O4/c1-11(2)10-14(17(23)24-3)20-15(21)8-9-19-16(22)12-4-6-13(18)7-5-12/h4-7,11,14H,8-10H2,1-3H3,(H,19,22)(H,20,21)